7-[3-(aminomethyl)-3-pyridin-4-yl-pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[3-(aminomethyl)-3-pyridin-4-yl-pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[3-(aminomethyl)-3-(4-pyridyl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[3-(aminomethyl)-3-pyridin-4-yl-1-pyrrolidinyl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[3-(aminomethyl)-3-pyridin-4-ylpyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[3-(aminomethyl)-3-(4-pyridyl)pyrrolidino]-1-cyclopropyl-6-fluoro-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C24H25FN4O4 MolecularWeight: 452.478103

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1N3CCC(C3)(CN)C4=CC=NC=C4)F)C(=O)C(=CN2C5CC5)C(=O)O

Isomeric SMILES

COC1=C2C(=CC(=C1N3CCC(C3)(CN)C4=CC=NC=C4)F)C(=O)C(=CN2C5CC5)C(=O)O

InChI

InChI=1S/C24H25FN4O4/c1-33-22-19-16(21(30)17(23(31)32)11-29(19)15-2-3-15)10-18(25)20(22)28-9-6-24(12-26,13-28)14-4-7-27-8-5-14/h4-5,7-8,10-11,15H,2-3,6,9,12-13,26H2,1H3,(H,31,32)